9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole

C202H124N8 — CID 158821382

IUPAC9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole
SMILESc1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc6ccccc56)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3ccc4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)c5ccc2c3c45)cc1
InChIInChI=1S/2C70H43N3.C62H38N2/c1-7-28-63-52(22-1)53-23-2-8-29-64(53)71(63)48-19-13-16-45(40-48)51-36-34-44-35-37-59-61(46-17-14-20-49(41-46)72-65-30-9-3-24-54(65)55-25-4-10-31-66(55)72)43-62(60-39-38-58(51)69(44)70(59)60)47-18-15-21-50(42-47)73-67-32-11-5-26-56(67)57-27-6-12-33-68(57)73;1-7-19-63-52(13-1)53-14-2-8-20-64(53)71(63)48-33-25-44(26-34-48)51-39-31-47-32-40-59-61(45-27-35-49(36-28-45)72-65-21-9-3-15-54(65)55-16-4-10-22-66(55)72)43-62(60-42-41-58(51)69(47)70(59)60)46-29-37-50(38-30-46)73-67-23-11-5-17-56(67)57-18-6-12-24-68(57)73;1-2-20-45-39(14-1)15-13-25-47(45)56-38-55(42-17-12-19-44(37-42)64-59-28-9-5-23-50(59)51-24-6-10-29-60(51)64)53-33-31-40-30-32-46(52-34-35-54(56)62(53)61(40)52)41-16-11-18-43(36-41)63-57-26-7-3-21-48(57)49-22-4-8-27-58(49)63/h2*1-43H;1-38H
InChIKeyIVXKCOIJFWJDAI-UHFFFAOYSA-N
MW2663.27 g/mol
LogP54.69
Rot. Bonds17

About 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole

9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole (PubChem CID 158821382) has the molecular formula C202H124N8 and a molecular weight of 2663.27 g/mol. Its IUPAC name is 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole
PubChem CID158821382
Molecular FormulaC202H124N8
Molecular Weight2663.27 g/mol
Exact Mass2660.99
IUPAC Name9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole
SMILESc1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc6ccccc56)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3ccc4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)c5ccc2c3c45)cc1
InChIInChI=1S/2C70H43N3.C62H38N2/c1-7-28-63-52(22-1)53-23-2-8-29-64(53)71(63)48-19-13-16-45(40-48)51-36-34-44-35-37-59-61(46-17-14-20-49(41-46)72-65-30-9-3-24-54(65)55-25-4-10-31-66(55)72)43-62(60-39-38-58(51)69(44)70(59)60)47-18-15-21-50(42-47)73-67-32-11-5-26-56(67)57-27-6-12-33-68(57)73;1-7-19-63-52(13-1)53-14-2-8-20-64(53)71(63)48-33-25-44(26-34-48)51-39-31-47-32-40-59-61(45-27-35-49(36-28-45)72-65-21-9-3-15-54(65)55-16-4-10-22-66(55)72)43-62(60-42-41-58(51)69(47)70(59)60)46-29-37-50(38-30-46)73-67-23-11-5-17-56(67)57-18-6-12-24-68(57)73;1-2-20-45-39(14-1)15-13-25-47(45)56-38-55(42-17-12-19-44(37-42)64-59-28-9-5-23-50(59)51-24-6-10-29-60(51)64)53-33-31-40-30-32-46(52-34-35-54(56)62(53)61(40)52)41-16-11-18-43(36-41)63-57-26-7-3-21-48(57)49-22-4-8-27-58(49)63/h2*1-43H;1-38H
InChIKeyIVXKCOIJFWJDAI-UHFFFAOYSA-N
XLogP54.69
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms210
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002663.27
LogP ≤ 554.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole with MolForge

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Related Compounds

9-[3-[6-(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole
CID 172537457
2-(3-carbazol-9-ylphenyl)-9-(4-naphthalen-1-ylphenyl)carbazole
CID 144560197
9-[3-[6-(4-methylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-(8-naphthalen-2-ylpyren-1-yl)phenyl]carbazole;9-[3-(6-phenylpyren-1-yl)phenyl]carbazole
CID 160792996
9-phenyl-2-[6-(9-phenylcarbazol-2-yl)pyren-1-yl]carbazole
CID 139341260
3-[9-(3-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-1-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159770105
7-phenyl-5-[3-[6-(3-phenylphenyl)pyren-1-yl]phenyl]indolo[2,3-b]carbazole
CID 176780561
N-(4-carbazol-9-ylphenyl)-4-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-[4-[3-(3-naphthalen-1-ylphenyl)phenyl]phenyl]aniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-(3-naphthalen-1-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline
CID 161173154
9-[4-(7-tert-butyl-3-methylpyren-1-yl)phenyl]carbazole;9-[4-(7-tert-butyl-3-naphthalen-1-ylpyren-1-yl)phenyl]carbazole;9-[4-(7-tert-butyl-3-phenylpyren-1-yl)phenyl]carbazole;9-[3-(7-tert-butylpyren-1-yl)-5-carbazol-9-ylphenyl]carbazole;9-[4-[4-(7-tert-butylpyren-1-yl)phenyl]phenyl]carbazole;9-[4-(3,7-ditert-butylpyren-1-yl)phenyl]carbazole
CID 160928553
1,6-dinaphthalen-2-yl-3,8-diphenylpyrene;1-naphthalen-1-yl-6-naphthalen-2-yl-8-phenyl-3-(2-phenylphenyl)pyrene;1-naphthalen-1-yl-8-(4-naphthalen-1-ylphenyl)pyrene
CID 158032644
3,9-bis(4-naphthalen-1-ylphenyl)carbazole;3-(4-naphthalen-1-ylphenyl)-9-(3-phenylphenyl)carbazole
CID 157309871
6-[9-(4-fluoranthen-3-ylphenyl)carbazol-3-yl]-2-[9-(3-fluoranthen-3-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazol-2-yl]-9-phenylcarbazole
CID 137420632
3-dibenzothiophen-4-yl-9-(2-phenanthren-9-ylphenyl)carbazole;3-dibenzothiophen-4-yl-9-(3-phenanthren-9-ylphenyl)carbazole;3-dibenzothiophen-4-yl-9-(4-phenanthren-9-ylphenyl)carbazole;3-dibenzothiophen-4-yl-9-(2-pyren-1-ylphenyl)carbazole;3-dibenzothiophen-4-yl-9-(3-pyren-1-ylphenyl)carbazole;3-dibenzothiophen-4-yl-9-(4-pyren-1-ylphenyl)carbazole
CID 159539858

Frequently Asked Questions

What is the IUPAC name of 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole?
The IUPAC name of 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole (CID 158821382) is 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole.
What is the SMILES notation for 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole?
The canonical SMILES for 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole is c1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1cc(-c2ccc3ccc4c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)cc(-c5cccc6ccccc56)c5ccc2c3c45)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3ccc4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)c5ccc2c3c45)cc1.
What is the InChIKey of 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole?
The InChIKey is IVXKCOIJFWJDAI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C70H43N3.C62H38N2/c1-7-28-63-52(22-1)53-23-2-8-29-64(53)71(63)48-19-13-16-45(40-48)51-36-34-44-35-37-59-61(46-17-14-20-49(41-46)72-65-30-9-3-24-54(65)55-25-4-10-31-66(55)72)43-62(60-39-38-58(51)69(44)70(59)60)47-18-15-21-50(42-47)73-67-32-11-5-26-56(67)57-27-6-12-33-68(57)73;1-7-19-63-52(13-1)53-14-2-8-20-64(53)71(63)48-33-25-44(26-34-48)51-39-31-47-32-40-59-61(45-27-35-49(36-28-45)72-65-21-9-3-15-54(65)55-16-4-10-22-66(55)72)43-62(60-42-41-58(51)69(47)70(59)60)46-29-37-50(38-30-46)73-67-23-11-5-17-56(67)57-18-6-12-24-68(57)73;1-2-20-45-39(14-1)15-13-25-47(45)56-38-55(42-17-12-19-44(37-42)64-59-28-9-5-23-50(59)51-24-6-10-29-60(51)64)53-33-31-40-30-32-46(52-34-35-54(56)62(53)61(40)52)41-16-11-18-43(36-41)63-57-26-7-3-21-48(57)49-22-4-8-27-58(49)63/h2*1-43H;1-38H.
What are the key properties of 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole?
9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole has a molecular weight of 2663.27 g/mol, XLogP of 54.69, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[3,8-bis(3-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[4-[3,8-bis(4-carbazol-9-ylphenyl)pyren-1-yl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-3-naphthalen-1-ylpyren-1-yl]phenyl]carbazole is sourced from PubChem (CID 158821382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).